2-(4-methoxyphenyl)-7-{[(4-methoxyphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-7-{[(4-methoxyphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(4-methoxyphenyl)-7-{[(4-methoxyphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-2646 |
| Compound Name: | 2-(4-methoxyphenyl)-7-{[(4-methoxyphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C20 H17 N3 O3 S2 |
| Smiles: | COc1ccc(cc1)C1=NN2C(=NC(CSc3ccc(cc3)OC)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0377 |
| logD: | 4.0375 |
| logSw: | -4.2333 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.087 |
| InChI Key: | GVAZHRMDNPRJCH-UHFFFAOYSA-N |